1-cyclohexyl-4-[5-(5-fluoranyl-2-methyl-1-benzofuran-7-yl)-2,3,4,7-tetrahydroazepin-1-yl]-2-pyridin-2-yl-butan-1-one

Systemtic Name: 1-cyclohexyl-4-[5-(5-fluoranyl-2-methyl-1-benzofuran-7-yl)-2,3,4,7-tetrahydroazepin-1-yl]-2-pyridin-2-yl-butan-1-one Openeye Name: 1-cyclohexyl-4-[5-(5-fluoro-2-methyl-benzofuran-7-yl)-2,3,4,7-tetrahydroazepin-1-yl]-2-(2-pyridyl)butan-1-one CAS Name: 1-cyclohexyl-4-[5-(5-fluoro-2-methyl-7-benzofuranyl)-2,3,4,7-tetrahydroazepin-1-yl]-2-(2-pyridinyl)-1-butanone IUPAC Name: 1-cyclohexyl-4-[5-(5-fluoro-2-methyl-1-benzofuran-7-yl)-2,3,4,7-tetrahydroazepin-1-yl]-2-pyridin-2-ylbutan-1-one Traditional Name: 1-cyclohexyl-4-[5-(5-fluoro-2-methyl-benzofuran-7-yl)-2,3,4,7-tetrahydroazepin-1-yl]-2-(2-pyridyl)butan-1-one Formula: C30H35FN2O2 MolecularWeight: 474.609503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=CC(=C2O1)C3=CCN(CCC3)CCC(C4=CC=CC=N4)C(=O)C5CCCCC5)F

Isomeric SMILES

CC1=CC2=CC(=CC(=C2O1)C3=CCN(CCC3)CCC(C4=CC=CC=N4)C(=O)C5CCCCC5)F

InChI

InChI=1S/C30H35FN2O2/c1-21-18-24-19-25(31)20-27(30(24)35-21)22-10-7-15-33(16-12-22)17-13-26(28-11-5-6-14-32-28)29(34)23-8-3-2-4-9-23/h5-6,11-12,14,18-20,23,26H,2-4,7-10,13,15-17H2,1H3